Ketcher 03032313472D 1   1.00000     0.00000     0

 19 18  0     0  0            999 V2000
   10.2208   -6.2628    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.8765   -5.2634    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.0110   -3.7643    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.8175   -4.7638    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9520   -5.2634    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6831   -5.2634    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0865   -4.7638    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5487   -4.7638    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2208   -5.2634    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4142   -5.2634    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3553   -4.7638    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2798   -4.7638    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4898   -5.2634    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.1453   -5.2634    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.0110   -4.7638    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6201   -4.7659    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7528   -5.2677    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8831   -4.7701    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0158   -5.2721    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  9  1  1  0     0  0
  2 15  1  0     0  0
  3 15  2  0     0  0
  4  5  1  0     0  0
  4  6  1  0     0  0
  5  7  1  0     0  0
  6  8  1  0     0  0
  7  9  1  0     0  0
  8 10  1  0     0  0
  9 11  1  0     0  0
 10 12  1  0     0  0
 11 13  1  0     0  0
 12 14  1  0     0  0
 14 15  1  0     0  0
 16 17  1  0     0  0
 17 18  1  0     0  0
 18 19  1  0     0  0
 13 16  1  0     0  0
M  END
> <ID>
CHEBI:194453

> <NAME>
10-hydroxypalmitic acid

> <DEFINITION>
A hydroxypalmitic acid that is palmitic (hexadecanoic) acid carrying a single hydroxy substituent at position 10.

> <STAR>
3

> <SYNONYM>
10-hydroxy-hexadecanoic acid

> <IUPAC_NAME>
10-hydroxyhexadecanoic acid

> <FORMULA>
C16H32O3

> <MASS>
272.429

> <MONOISOTOPIC_MASS>
272.23514

> <CHARGE>
0

> <SMILES>
CCCCCCC(O)CCCCCCCCC(O)=O

> <INCHI>
InChI=1S/C16H32O3/c1-2-3-4-9-12-15(17)13-10-7-5-6-8-11-14-16(18)19/h15,17H,2-14H2,1H3,(H,18,19)

> <INCHIKEY>
QUFMVAWAOYDYFV-UHFFFAOYSA-N

> <CAS_REGISTRY_NUMBER>
23048-75-1

> <PUBMED_CITATION>
26956722; 32872426; 4819753; 9397400

$$$$